Glycine, 4-methylbenzenesulfonate
TL;DR: Glycine, 4-methylbenzenesulfonate (CAS 4571-30-6) is a chemical compound with molecular formula C9H13NO5S and molecular weight 247.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-aminoacetic acid;4-methylbenzenesulfonic acid
Also Known As: glycine tosylate, Glycine, 4-methylbenzenesulfonate, 2-aminoacetic acid; 4-methylbenzenesulfonic acid, Glycine--4-methylbenzenesulfonic acid (1/1), 2-aminoacetic acid,4-methylbenzenesulfonic acid
| Molecular Formula | C9H13NO5S |
|---|---|
| Molecular Weight | 247.05 g/mol |
| LogP | 0.27142 |
| Topological Polar Surface Area | 117.69 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.05144 |
| Heavy Atoms | 16 |
| Complexity | 437.47208 |
Chemical Identifiers
| CAS Number | 4571-30-6 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)O.C(C(=O)O)N |
Product Overview
Glycine, 4-methylbenzenesulfonate (CAS 4571-30-6), with molecular formula C9H13NO5S and molecular weight 247.05 g/mol. IUPAC: 2-aminoacetic acid;4-methylbenzenesulfonic acid.
Chemical Property Profile of Glycine, 4-methylbenzenesulfonate
Property Insights of Glycine, 4-methylbenzenesulfonate
The XLogP value of 0.27142 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Glycine, 4-methylbenzenesulfonate. The TPSA of 117.69 Ų falls within the moderate polarity range, balancing permeability and solubility for Glycine, 4-methylbenzenesulfonate. Following Lipinski's Rule of Five, Glycine, 4-methylbenzenesulfonate has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Glycine, 4-methylbenzenesulfonate?
The CAS number of Glycine, 4-methylbenzenesulfonate is 4571-30-6.
What is the molecular formula of Glycine, 4-methylbenzenesulfonate?
The molecular formula of Glycine, 4-methylbenzenesulfonate is C9H13NO5S.
What is the molecular weight of Glycine, 4-methylbenzenesulfonate?
The molecular weight of Glycine, 4-methylbenzenesulfonate is 247.05 g/mol.
Where can I buy Glycine, 4-methylbenzenesulfonate?
You can request a quote for Glycine, 4-methylbenzenesulfonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Glycine, 4-methylbenzenesulfonate?
Yes, KEHONG BIO provides custom synthesis services for Glycine, 4-methylbenzenesulfonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.